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Atom-Mass pairs
Related entries (identical compound): KO001179 KO001178 KO001175 KO001177 KO001176 KZ000231 KZ000232 KZ000233 GLS00013 KNA00041 KNA00042 KNA00043 KO003173 KO003172 KO003176 KO003175 KO003174 KNA00321 KNA00320 KNA00322 PR030010 OUF00312 PR010061 OUF01004
Submission id: KO003174

Outputs for L-Isoleucine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003174
Synonyms: Ile, 2-Amino-3-methylvaleric acid, L-Isoleucine
Total mass: 131.1724
Formula: H13 C6 O2 N1

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 43.0, 45.1, 56.1, 57.2, 59.1, 68.0, 98.0,
Processing time: 0:00:01.851936
Queried mass list: ['30.100', '41.000', '44.100', '55.200', '58.100', '67.000', '69.300', '73.000', '86.200', '97.100', '99.900', '115.100']



Queried massNum. matched formulasNum. matched fragments
30.1 (link to fragments) 3 3
41.0 (link to fragments) 3 7
44.1 (link to fragments) 1 1
55.2 (link to fragments) 4 8
58.1 (link to fragments) 4 6
67.0 (link to fragments) 5 10
69.3 (link to fragments) 5 10
73.0 (link to fragments) 2 2
86.2 (link to fragments) 1 1
97.1 (link to fragments) 1 1
99.9 (link to fragments) 1 1
115.1 (link to fragments) 3 5


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